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T0070907

CAT: 1568-C08926-03Size: 25 mgDry Ice: YesHazardous: No
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CAT#:1568-C08926-03Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
313516-66-4
SKU
C08926-5mg
Target
PPAR
Applications
DNA Damage/DNA Repair
Smiles
C1=CC (=C (C=C1[N+] (=O) [O-]) C (=O) NC2=CC=NC=C2) Cl
Molecular Formula
C12H8ClN3O3
Additionnal Information
T0070907 is a potent inhibitor of PPARγ (peroxisome proliferator activator receptor γ) that induces G2/M arrest and enhances the effect of radiation in human cervical cancer cells through mitotic catastrophe. It also acts as an antagonist of PPARγ that suppresses breast cancer cell proliferation and motility via both PPARgamma-dependent and -independent mechanisms.
Storage Conditions
2 years -80 in solvent

Chemical Information

2-Chloro-5-nitro-N-4-pyridinylbenzamide

2-chloro-5-nitro-N-pyridin-4-ylbenzamide is an organohalogen compound and a carbonyl compound.

CAS Number313516-66-4
PubChem CID2777391
IUPAC Name2-chloro-5-nitro-N-pyridin-4-ylbenzamide
Molecular FormulaC12H8ClN3O3
Molecular Weight277.66
XLogP2.3
Topological Polar Surface Area87.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity342
SMILES
C1=CC(=C(C=C1[N+](=O)[O-])C(=O)NC2=CC=NC=C2)Cl
InChI
InChI=1S/C12H8ClN3O3/c13-11-2-1-9(16(18)19)7-10(11)12(17)15-8-3-5-14-6-4-8/h1-7H,(H,14,15,17)
InChIKey
FRPJSHKMZHWJBE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-Chloro-5-nitro-N-4-pyridinylbenzamide
CAS: 313516-66-4
CID: 2777391
Formula: C12H8ClN3O3
MW: 277.66
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight277.66
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass277.0254188
Monoisotopic Mass277.0254188
Topological Polar Surface Area87.8 Ų
Heavy Atom Count19
Formal Charge0
Complexity342
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes